2-(6-iodopyridazin-3-yl)morpholine

C8H10IN3O — CID 134406458

IUPAC2-(6-iodopyridazin-3-yl)morpholine
SMILESIc1ccc(C2CNCCO2)nn1
InChIInChI=1S/C8H10IN3O/c9-8-2-1-6(11-12-8)7-5-10-3-4-13-7/h1-2,7,10H,3-5H2
InChIKeyOLMVGMMVKSNTHT-UHFFFAOYSA-N
MW291.09 g/mol
LogP0.74
Rot. Bonds1

About 2-(6-iodopyridazin-3-yl)morpholine

2-(6-iodopyridazin-3-yl)morpholine (PubChem CID 134406458) has the molecular formula C8H10IN3O and a molecular weight of 291.09 g/mol. Its IUPAC name is 2-(6-iodopyridazin-3-yl)morpholine.

Molecular Properties

Compound Name2-(6-iodopyridazin-3-yl)morpholine
PubChem CID134406458
Molecular FormulaC8H10IN3O
Molecular Weight291.09 g/mol
Exact Mass290.99
IUPAC Name2-(6-iodopyridazin-3-yl)morpholine
SMILESIc1ccc(C2CNCCO2)nn1
InChIInChI=1S/C8H10IN3O/c9-8-2-1-6(11-12-8)7-5-10-3-4-13-7/h1-2,7,10H,3-5H2
InChIKeyOLMVGMMVKSNTHT-UHFFFAOYSA-N
XLogP0.74
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.09
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(6-iodopyridazin-3-yl)morpholine?
The IUPAC name of 2-(6-iodopyridazin-3-yl)morpholine (CID 134406458) is 2-(6-iodopyridazin-3-yl)morpholine.
What is the SMILES notation for 2-(6-iodopyridazin-3-yl)morpholine?
The canonical SMILES for 2-(6-iodopyridazin-3-yl)morpholine is Ic1ccc(C2CNCCO2)nn1.
What is the InChIKey of 2-(6-iodopyridazin-3-yl)morpholine?
The InChIKey is OLMVGMMVKSNTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10IN3O/c9-8-2-1-6(11-12-8)7-5-10-3-4-13-7/h1-2,7,10H,3-5H2.
What are the key properties of 2-(6-iodopyridazin-3-yl)morpholine?
2-(6-iodopyridazin-3-yl)morpholine has a molecular weight of 291.09 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-iodopyridazin-3-yl)morpholine is sourced from PubChem (CID 134406458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).